1-(1-Isocyanato-1-methylethyl)-3-(1-methylethenyl)benzene
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1-(1-Isocyanato-1-methylethyl)-3-(1-methylethenyl)benzene
structure -
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CAS No:
2094-99-7
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Formula:
C13H15NO
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Chemical Name:
1-(1-Isocyanato-1-methylethyl)-3-(1-methylethenyl)benzene
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Synonyms:
Benzene,1-(1-isocyanato-1-methylethyl)-3-(1-methylethenyl)-;Isocyanic acid,m-isopropenyl-α,α-dimethylbenzyl ester;1-(1-Isocyanato-1-methylethyl)-3-(1-methylethenyl)benzene;3-Isopropenyl-α,α-dimethylbenzyl isocyanate;m-TMI;TMI;m-Isopropenyl-α,α-dimethylbenzyl isocyanate;Takenate TMI;meta-TMI;Dimethyl-m-isopropenylbenzyl isocyanate;m-Isopropenylcumyl isocyanate;α,α-Dimethyl-m-isopropenylbenzyl isocyanate;Cytec TMI;m-Isopropenyldimethylbenzyl isocyanate;3-Isopropenyl-α,α′-dimethylbenzyl isocyanate;1-(1-Isocyanato-1-methylethyl)-3-isopropenylbenzene;m-Isoprenyl-α,α′-dimethylbenzyl isocyanate;1-(2-Isocyanatopropan-2-yl)-3-(prop-1-en-2-yl)benzene;1-(2-Isocyanatopropan-2-yl)-3-prop-1-en-2-ylbenzene;138273-17-3;153929-64-7;163620-50-6
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CAS No:
1-(1-Isocyanato-1-methylethyl)-3-(1-methylethenyl)benzene Basic Attributes
201.26
201.26
402-440-2
RY29G3V80M
DTXSID9044871
2929109000
Characteristics
29.4
3.29060
Liquid
1.018 g/mL at 25 °C(lit.)
269.5 °C
>230 °F
n20/D 1.53(lit.)
0.00723mmHg at 25°C
Safety Information
II
6.1(a)
UN 2206 6.1/PG 3
2
26-34-42/43-48/20-50/53
7-15-28-36/37/39-38-45-60-61
DA3685000
T+,N
P260-P280-P284-P303 + P361 + P353-P304 + P340 + P310-P305 + P351 + P338-P342 + P311-P403 + P233
H314-H317-H330-H334-H373-H410
|Danger|H314: Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P261, P264, P271, P272, P273, P280, P284, P285, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P304+P341, P305+P351+P338, P310, P314, P320, P321, P333+P313, P342+P311, P363, P391, P403+P233, P405, and P501|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|Aggregated GHS information provided by 108 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Aggregated GHS information provided by 179 companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
1-(1-Isocyanato-1-methylethyl)-3-(1-methylethenyl)benzene Use and Manufacturing
Adhesives and sealant chemicals
500,000 - 1,000,000 lb
Adhesive manufacturing|Benzene, 1-(1-isocyanato-1-methylethyl)-3-(1-methylethenyl)-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Computed Properties
Molecular Weight:201.26
XLogP3:4.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:201.115364102
Monoisotopic Mass:201.115364102
Topological Polar Surface Area:29.4
Heavy Atom Count:15
Complexity:287
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-(1-Isocyanato-1-methylethyl)-3-(1-methylethenyl)benzene
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